D110000

Sigma-Aldrich

3,5-Dihydroxybenzoic acid

97%

Synonym(s):
α-Resorcylic acid
Linear Formula:
(HO)2C6H3CO2H
CAS Number:
Molecular Weight:
154.12
Beilstein/REAXYS Number:
2207864
EC Number:
MDL number:
PubChem Substance ID:
NACRES:
NA.22

Quality Level

assay

97%

mp

236-238 °C (dec.) (lit.)

SMILES string

OC(=O)c1cc(O)cc(O)c1

InChI

1S/C7H6O4/c8-5-1-4(7(10)11)2-6(9)3-5/h1-3,8-9H,(H,10,11)

InChI key

UYEMGAFJOZZIFP-UHFFFAOYSA-N

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Pictograms

Exclamation mark

Signal Word

Warning

Hazard Statements

Personal Protective Equipment

dust mask type N95 (US),Eyeshields,Gloves

RIDADR

NONH for all modes of transport

WGK Germany

WGK 1

Flash Point(F)

392.0 °F - closed cup

Flash Point(C)

200 °C - closed cup

Yingdong Zhu et al.
The Journal of nutrition, 144(2), 114-122 (2013-11-22)
Biomarkers of dietary intake are prominent tools in nutritional research. The alkylresorcinol metabolites 3,5-dihydroxybenzoic acid (3,5-DHBA) and 3-(3,5-dihydroxyphenyl)propanoic acid (3,5-DHPPA) have been proposed as exposure biomarkers of whole-grain (WG) wheat and rye intake. However, the profile of alkylresorcinol metabolites is...
Sunil Varughese et al.
Chemistry (Weinheim an der Bergstrasse, Germany), 12(6), 1597-1609 (2005-10-27)
A molecular recognition study of 3,5-dihydroxybenzoic acid (1) and its bromo derivative 4-bromo-3,5-dihydroxybenzoic acid (2) with the N-donor compounds 1,2-bis(4-pyridyl)ethene (bpyee), 1,2-bis(4-pyridyl)ethane (bpyea), and 4,4'-bipyridine (bpy) is reported. Thus, the syntheses and structural analysis of molecular adducts 1 a-1 c...
Anja Koskela et al.
Clinical chemistry, 53(7), 1380-1383 (2007-05-15)
Whole-grain rye and wheat cereals contain high amounts of alkylresorcinols (ARs), phenolic lipids. ARs can be quantified in plasma. Two recently identified urinary AR metabolites, 3,5-dihydroxyphenylbenzoic acid (DHBA) and 3-(3,5-dihydroxyphenyl)-1-propanoic acid (DHPPA), may be useful as biomarkers of intake of...
Yasuyo Seshime et al.
Bioorganic & medicinal chemistry letters, 20(16), 4785-4788 (2010-07-16)
As a novel superfamily of type III polyketide synthases in microbes, four genes csyA, csyB, csyC, and csyD, were found in the genome of Aspergillus oryzae, an industrially important filamentous fungus. In order to analyze their functions, we carried out...
Seetharaman Vaidyanathan et al.
Rapid communications in mass spectrometry : RCM, 20(8), 1192-1198 (2006-03-17)
Matrix-assisted laser desorption/ionisation (MALDI) mass spectrometry was investigated for the simultaneous detection of several metabolites, as applicable to global metabolite analysis (metabolomics). The commonly employed organic matrices alpha-cyano-4-hydroxycinnamic acid and 3,5-dihydroxybenzoic acid, in both the crystalline and ionic liquid forms...

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